USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 590 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 193 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 179 THR OG1 : rot -73:sc= 0.843 USER MOD Set 2.2: A 181 SER OG : rot 180:sc= 0.163 USER MOD Set 2.3: A 182 GLN : amide:sc= 1.61 K(o=2.6,f=-4.5!) USER MOD Set 3.1: A 162 TYR OH : rot -137:sc= 0.00792 USER MOD Set 3.2: A 209 SER OG : rot 78:sc= 0.828 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot 81:sc= 0.84 USER MOD Single : A 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 172 SER OG : rot 82:sc= 1.24 USER MOD Single : A 173 SER OG : rot -79:sc= 1.39 USER MOD Single : A 176 LYS NZ :NH3+ 168:sc= 1.74 (180deg=1.53) USER MOD Single : A 184 TYR OH : rot 180:sc= 0 USER MOD Single : A 187 MET CE :methyl -147:sc= 0 (180deg=-0.561) USER MOD Single : A 189 LYS NZ :NH3+ -168:sc=-0.00787 (180deg=-0.129) USER MOD Single : A 190 SER OG : rot 163:sc= 0.885 USER MOD Single : A 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN : amide:sc= -0.154 X(o=-0.15,f=0) USER MOD Single : A 202 SER OG : rot -123:sc= 0.636 USER MOD Single : A 203 SER OG : rot 57:sc= 0.245 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 208 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 212 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 213 ASN : amide:sc= 0.772 K(o=0.77,f=-0.079) USER MOD Single : A 215 SER OG : rot 83:sc= 1.26 USER MOD Single : A 217 HIS : no HE2:sc= 0.536 K(o=0.54,f=-1.9!) USER MOD Single : A 218 SER OG : rot 180:sc= 0.0116 USER MOD Single : A 219 LYS NZ :NH3+ -152:sc= 0.896 (180deg=0.461) USER MOD Single : A 224 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 232 SER OG : rot 35:sc= 0.143 USER MOD Single : A 235 MET CE :methyl -175:sc= -0.0514 (180deg=-0.103) USER MOD Single : A 237 ASN : amide:sc= -0.63 K(o=-0.63,f=-4.2!) USER MOD ----------------------------------------------------------------- ATOM 116 N LEU A 160 -13.085 13.733 -2.452 1.00 0.00 N ATOM 117 CA LEU A 160 -13.619 14.901 -3.139 1.00 0.00 C ATOM 118 C LEU A 160 -15.136 14.771 -3.180 1.00 0.00 C ATOM 119 O LEU A 160 -15.675 13.671 -3.306 1.00 0.00 O ATOM 120 CB LEU A 160 -13.059 14.976 -4.563 1.00 0.00 C ATOM 121 CG LEU A 160 -11.583 15.382 -4.689 1.00 0.00 C ATOM 122 CD1 LEU A 160 -11.111 15.189 -6.130 1.00 0.00 C ATOM 123 CD2 LEU A 160 -11.357 16.836 -4.264 1.00 0.00 C ATOM 0 HA LEU A 160 -13.332 15.811 -2.613 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -13.188 14.002 -5.034 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -13.660 15.686 -5.131 1.00 0.00 H new ATOM 0 HG LEU A 160 -11.005 14.742 -4.021 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -10.063 15.479 -6.212 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -11.221 14.142 -6.412 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -11.712 15.809 -6.796 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -10.301 17.085 -4.367 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -11.949 17.496 -4.897 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -11.660 16.962 -3.225 1.00 0.00 H new ATOM 135 N SER A 161 -15.826 15.895 -3.079 1.00 0.00 N ATOM 136 CA SER A 161 -17.285 15.899 -3.098 1.00 0.00 C ATOM 137 C SER A 161 -17.769 15.597 -4.506 1.00 0.00 C ATOM 138 O SER A 161 -17.016 15.715 -5.467 1.00 0.00 O ATOM 139 CB SER A 161 -17.819 17.266 -2.666 1.00 0.00 C ATOM 140 OG SER A 161 -17.338 17.611 -1.382 1.00 0.00 O ATOM 0 H SER A 161 -15.402 16.818 -2.983 1.00 0.00 H new ATOM 0 HA SER A 161 -17.649 15.140 -2.406 1.00 0.00 H new ATOM 0 HB2 SER A 161 -17.516 18.024 -3.388 1.00 0.00 H new ATOM 0 HB3 SER A 161 -18.909 17.250 -2.659 1.00 0.00 H new ATOM 0 HG SER A 161 -17.690 18.489 -1.126 1.00 0.00 H new ATOM 146 N TYR A 162 -19.036 15.230 -4.643 1.00 0.00 N ATOM 147 CA TYR A 162 -19.595 14.956 -5.966 1.00 0.00 C ATOM 148 C TYR A 162 -19.399 16.147 -6.891 1.00 0.00 C ATOM 149 O TYR A 162 -18.977 15.977 -8.016 1.00 0.00 O ATOM 150 CB TYR A 162 -21.087 14.642 -5.877 1.00 0.00 C ATOM 151 CG TYR A 162 -21.385 13.181 -5.637 1.00 0.00 C ATOM 152 CD1 TYR A 162 -21.598 12.687 -4.334 1.00 0.00 C ATOM 153 CD2 TYR A 162 -21.460 12.281 -6.719 1.00 0.00 C ATOM 154 CE1 TYR A 162 -21.884 11.311 -4.118 1.00 0.00 C ATOM 155 CE2 TYR A 162 -21.749 10.911 -6.507 1.00 0.00 C ATOM 156 CZ TYR A 162 -21.958 10.439 -5.206 1.00 0.00 C ATOM 157 OH TYR A 162 -22.238 9.114 -4.994 1.00 0.00 O ATOM 0 H TYR A 162 -19.690 15.115 -3.869 1.00 0.00 H new ATOM 0 HA TYR A 162 -19.068 14.090 -6.367 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -21.526 15.231 -5.072 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -21.571 14.956 -6.802 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -21.543 13.360 -3.491 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -21.295 12.641 -7.724 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -22.043 10.942 -3.116 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -21.808 10.233 -7.346 1.00 0.00 H new ATOM 0 HH TYR A 162 -21.653 8.562 -5.555 1.00 0.00 H new ATOM 167 N ALA A 163 -19.692 17.350 -6.416 1.00 0.00 N ATOM 168 CA ALA A 163 -19.542 18.545 -7.242 1.00 0.00 C ATOM 169 C ALA A 163 -18.094 18.705 -7.719 1.00 0.00 C ATOM 170 O ALA A 163 -17.849 19.066 -8.868 1.00 0.00 O ATOM 171 CB ALA A 163 -19.983 19.783 -6.454 1.00 0.00 C ATOM 0 H ALA A 163 -20.032 17.526 -5.471 1.00 0.00 H new ATOM 0 HA ALA A 163 -20.176 18.437 -8.122 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -19.868 20.670 -7.076 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -21.028 19.676 -6.163 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -19.367 19.884 -5.561 1.00 0.00 H new ATOM 177 N ASP A 164 -17.149 18.425 -6.837 1.00 0.00 N ATOM 178 CA ASP A 164 -15.730 18.568 -7.151 1.00 0.00 C ATOM 179 C ASP A 164 -15.340 17.578 -8.243 1.00 0.00 C ATOM 180 O ASP A 164 -14.622 17.913 -9.173 1.00 0.00 O ATOM 181 CB ASP A 164 -14.862 18.288 -5.916 1.00 0.00 C ATOM 182 CG ASP A 164 -15.294 19.076 -4.687 1.00 0.00 C ATOM 183 OD1 ASP A 164 -15.001 18.596 -3.567 1.00 0.00 O ATOM 184 OD2 ASP A 164 -15.935 20.137 -4.817 1.00 0.00 O ATOM 0 H ASP A 164 -17.337 18.095 -5.890 1.00 0.00 H new ATOM 0 HA ASP A 164 -15.564 19.592 -7.485 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -14.899 17.223 -5.688 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -13.824 18.528 -6.147 1.00 0.00 H new ATOM 189 N LEU A 165 -15.827 16.350 -8.127 1.00 0.00 N ATOM 190 CA LEU A 165 -15.520 15.298 -9.097 1.00 0.00 C ATOM 191 C LEU A 165 -16.174 15.552 -10.451 1.00 0.00 C ATOM 192 O LEU A 165 -15.564 15.324 -11.489 1.00 0.00 O ATOM 193 CB LEU A 165 -15.984 13.942 -8.561 1.00 0.00 C ATOM 194 CG LEU A 165 -15.197 13.396 -7.365 1.00 0.00 C ATOM 195 CD1 LEU A 165 -15.920 12.187 -6.793 1.00 0.00 C ATOM 196 CD2 LEU A 165 -13.776 13.005 -7.777 1.00 0.00 C ATOM 0 H LEU A 165 -16.440 16.053 -7.368 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.440 15.299 -9.241 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -17.033 14.024 -8.275 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -15.930 13.214 -9.371 1.00 0.00 H new ATOM 0 HG LEU A 165 -15.129 14.177 -6.608 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -15.361 11.798 -5.942 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -16.918 12.480 -6.468 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -16.000 11.415 -7.558 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.239 12.621 -6.910 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -13.819 12.235 -8.548 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -13.256 13.880 -8.167 1.00 0.00 H new ATOM 208 N ILE A 166 -17.408 16.036 -10.442 1.00 0.00 N ATOM 209 CA ILE A 166 -18.112 16.366 -11.684 1.00 0.00 C ATOM 210 C ILE A 166 -17.321 17.472 -12.378 1.00 0.00 C ATOM 211 O ILE A 166 -17.090 17.431 -13.582 1.00 0.00 O ATOM 212 CB ILE A 166 -19.564 16.862 -11.401 1.00 0.00 C ATOM 213 CG1 ILE A 166 -20.413 15.744 -10.779 1.00 0.00 C ATOM 214 CG2 ILE A 166 -20.255 17.313 -12.686 1.00 0.00 C ATOM 215 CD1 ILE A 166 -21.637 16.263 -10.010 1.00 0.00 C ATOM 0 H ILE A 166 -17.946 16.210 -9.593 1.00 0.00 H new ATOM 0 HA ILE A 166 -18.186 15.476 -12.309 1.00 0.00 H new ATOM 0 HB ILE A 166 -19.480 17.701 -10.710 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -20.748 15.071 -11.568 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -19.790 15.158 -10.103 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -21.265 17.653 -12.456 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -19.691 18.130 -13.135 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -20.304 16.478 -13.385 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -22.191 15.420 -9.597 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -21.308 16.913 -9.199 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -22.281 16.824 -10.687 1.00 0.00 H new ATOM 227 N THR A 167 -16.892 18.453 -11.603 1.00 0.00 N ATOM 228 CA THR A 167 -16.096 19.549 -12.133 1.00 0.00 C ATOM 229 C THR A 167 -14.766 19.039 -12.671 1.00 0.00 C ATOM 230 O THR A 167 -14.356 19.416 -13.761 1.00 0.00 O ATOM 231 CB THR A 167 -15.834 20.591 -11.039 1.00 0.00 C ATOM 232 OG1 THR A 167 -17.074 21.162 -10.617 1.00 0.00 O ATOM 233 CG2 THR A 167 -14.921 21.685 -11.507 1.00 0.00 C ATOM 0 H THR A 167 -17.081 18.514 -10.603 1.00 0.00 H new ATOM 0 HA THR A 167 -16.655 20.009 -12.948 1.00 0.00 H new ATOM 0 HB THR A 167 -15.345 20.080 -10.209 1.00 0.00 H new ATOM 0 HG1 THR A 167 -17.513 20.558 -9.982 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.765 22.399 -10.699 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.963 21.258 -11.804 1.00 0.00 H new ATOM 0 HG23 THR A 167 -15.371 22.195 -12.359 1.00 0.00 H new ATOM 241 N LYS A 168 -14.093 18.170 -11.924 1.00 0.00 N ATOM 242 CA LYS A 168 -12.811 17.616 -12.365 1.00 0.00 C ATOM 243 C LYS A 168 -12.957 16.896 -13.690 1.00 0.00 C ATOM 244 O LYS A 168 -12.067 16.969 -14.522 1.00 0.00 O ATOM 245 CB LYS A 168 -12.253 16.633 -11.340 1.00 0.00 C ATOM 246 CG LYS A 168 -11.483 17.271 -10.195 1.00 0.00 C ATOM 247 CD LYS A 168 -10.100 16.633 -10.026 1.00 0.00 C ATOM 248 CE LYS A 168 -9.141 17.050 -11.159 1.00 0.00 C ATOM 249 NZ LYS A 168 -7.789 16.403 -11.018 1.00 0.00 N ATOM 0 H LYS A 168 -14.409 17.833 -11.014 1.00 0.00 H new ATOM 0 HA LYS A 168 -12.125 18.455 -12.476 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -13.079 16.055 -10.926 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -11.597 15.929 -11.852 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -11.372 18.339 -10.380 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -12.050 17.165 -9.270 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -9.678 16.927 -9.065 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -10.198 15.548 -10.013 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -9.575 16.777 -12.121 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -9.027 18.134 -11.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -7.174 16.709 -11.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -7.363 16.683 -10.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -7.895 15.369 -11.046 1.00 0.00 H new ATOM 263 N ALA A 169 -14.072 16.215 -13.889 1.00 0.00 N ATOM 264 CA ALA A 169 -14.328 15.526 -15.143 1.00 0.00 C ATOM 265 C ALA A 169 -14.376 16.517 -16.301 1.00 0.00 C ATOM 266 O ALA A 169 -13.761 16.303 -17.344 1.00 0.00 O ATOM 267 CB ALA A 169 -15.647 14.760 -15.048 1.00 0.00 C ATOM 0 H ALA A 169 -14.816 16.124 -13.197 1.00 0.00 H new ATOM 0 HA ALA A 169 -13.517 14.823 -15.330 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.837 14.244 -15.989 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -15.587 14.031 -14.240 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.459 15.458 -14.847 1.00 0.00 H new ATOM 273 N ILE A 170 -15.106 17.601 -16.106 1.00 0.00 N ATOM 274 CA ILE A 170 -15.276 18.608 -17.149 1.00 0.00 C ATOM 275 C ILE A 170 -13.932 19.273 -17.436 1.00 0.00 C ATOM 276 O ILE A 170 -13.587 19.528 -18.582 1.00 0.00 O ATOM 277 CB ILE A 170 -16.328 19.665 -16.715 1.00 0.00 C ATOM 278 CG1 ILE A 170 -17.714 19.001 -16.560 1.00 0.00 C ATOM 279 CG2 ILE A 170 -16.409 20.791 -17.745 1.00 0.00 C ATOM 280 CD1 ILE A 170 -18.690 19.786 -15.673 1.00 0.00 C ATOM 0 H ILE A 170 -15.593 17.810 -15.235 1.00 0.00 H new ATOM 0 HA ILE A 170 -15.636 18.127 -18.058 1.00 0.00 H new ATOM 0 HB ILE A 170 -16.021 20.085 -15.757 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -18.158 18.876 -17.548 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -17.582 18.003 -16.142 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -17.151 21.523 -17.426 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -15.436 21.274 -17.833 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -16.698 20.379 -18.712 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -19.639 19.253 -15.616 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -18.270 19.888 -14.672 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -18.855 20.775 -16.100 1.00 0.00 H new ATOM 292 N GLU A 171 -13.166 19.537 -16.392 1.00 0.00 N ATOM 293 CA GLU A 171 -11.851 20.163 -16.538 1.00 0.00 C ATOM 294 C GLU A 171 -10.869 19.265 -17.256 1.00 0.00 C ATOM 295 O GLU A 171 -9.981 19.735 -17.963 1.00 0.00 O ATOM 296 CB GLU A 171 -11.269 20.451 -15.165 1.00 0.00 C ATOM 297 CG GLU A 171 -11.981 21.520 -14.437 1.00 0.00 C ATOM 298 CD GLU A 171 -11.355 22.880 -14.682 1.00 0.00 C ATOM 299 OE1 GLU A 171 -11.249 23.286 -15.867 1.00 0.00 O ATOM 300 OE2 GLU A 171 -10.959 23.540 -13.702 1.00 0.00 O ATOM 0 H GLU A 171 -13.428 19.329 -15.428 1.00 0.00 H new ATOM 0 HA GLU A 171 -11.998 21.074 -17.117 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -11.294 19.538 -14.570 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -10.222 20.732 -15.275 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -13.025 21.539 -14.749 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -11.971 21.302 -13.369 1.00 0.00 H new ATOM 307 N SER A 172 -11.033 17.970 -17.051 1.00 0.00 N ATOM 308 CA SER A 172 -10.148 16.977 -17.665 1.00 0.00 C ATOM 309 C SER A 172 -10.424 16.861 -19.155 1.00 0.00 C ATOM 310 O SER A 172 -9.558 16.456 -19.924 1.00 0.00 O ATOM 311 CB SER A 172 -10.335 15.603 -17.027 1.00 0.00 C ATOM 312 OG SER A 172 -10.043 15.639 -15.638 1.00 0.00 O ATOM 0 H SER A 172 -11.769 17.574 -16.465 1.00 0.00 H new ATOM 0 HA SER A 172 -9.124 17.314 -17.503 1.00 0.00 H new ATOM 0 HB2 SER A 172 -11.361 15.266 -17.177 1.00 0.00 H new ATOM 0 HB3 SER A 172 -9.686 14.879 -17.519 1.00 0.00 H new ATOM 0 HG SER A 172 -10.822 15.975 -15.148 1.00 0.00 H new ATOM 318 N SER A 173 -11.635 17.204 -19.563 1.00 0.00 N ATOM 319 CA SER A 173 -11.979 17.160 -20.975 1.00 0.00 C ATOM 320 C SER A 173 -11.288 18.325 -21.678 1.00 0.00 C ATOM 321 O SER A 173 -11.264 19.444 -21.168 1.00 0.00 O ATOM 322 CB SER A 173 -13.491 17.240 -21.159 1.00 0.00 C ATOM 323 OG SER A 173 -13.969 18.561 -21.046 1.00 0.00 O ATOM 0 H SER A 173 -12.387 17.512 -18.947 1.00 0.00 H new ATOM 0 HA SER A 173 -11.643 16.218 -21.409 1.00 0.00 H new ATOM 0 HB2 SER A 173 -13.758 16.840 -22.137 1.00 0.00 H new ATOM 0 HB3 SER A 173 -13.980 16.613 -20.414 1.00 0.00 H new ATOM 0 HG SER A 173 -14.025 18.809 -20.099 1.00 0.00 H new ATOM 329 N ALA A 174 -10.729 18.069 -22.851 1.00 0.00 N ATOM 330 CA ALA A 174 -10.037 19.112 -23.607 1.00 0.00 C ATOM 331 C ALA A 174 -11.020 20.201 -24.044 1.00 0.00 C ATOM 332 O ALA A 174 -10.662 21.360 -24.193 1.00 0.00 O ATOM 333 CB ALA A 174 -9.351 18.494 -24.830 1.00 0.00 C ATOM 0 H ALA A 174 -10.738 17.154 -23.302 1.00 0.00 H new ATOM 0 HA ALA A 174 -9.283 19.570 -22.967 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -8.836 19.274 -25.391 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -8.629 17.746 -24.503 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -10.099 18.022 -25.467 1.00 0.00 H new ATOM 339 N GLU A 175 -12.264 19.801 -24.256 1.00 0.00 N ATOM 340 CA GLU A 175 -13.304 20.711 -24.724 1.00 0.00 C ATOM 341 C GLU A 175 -13.971 21.495 -23.586 1.00 0.00 C ATOM 342 O GLU A 175 -14.831 22.336 -23.839 1.00 0.00 O ATOM 343 CB GLU A 175 -14.381 19.907 -25.461 1.00 0.00 C ATOM 344 CG GLU A 175 -13.860 19.084 -26.638 1.00 0.00 C ATOM 345 CD GLU A 175 -14.976 18.358 -27.391 1.00 0.00 C ATOM 346 OE1 GLU A 175 -16.167 18.706 -27.212 1.00 0.00 O ATOM 347 OE2 GLU A 175 -14.656 17.443 -28.169 1.00 0.00 O ATOM 0 H GLU A 175 -12.582 18.843 -24.110 1.00 0.00 H new ATOM 0 HA GLU A 175 -12.823 21.433 -25.383 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -14.866 19.237 -24.751 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -15.145 20.594 -25.824 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -13.329 19.740 -27.328 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -13.138 18.353 -26.274 1.00 0.00 H new ATOM 354 N LYS A 176 -13.584 21.201 -22.343 1.00 0.00 N ATOM 355 CA LYS A 176 -14.172 21.813 -21.139 1.00 0.00 C ATOM 356 C LYS A 176 -15.683 21.631 -21.061 1.00 0.00 C ATOM 357 O LYS A 176 -16.396 22.481 -20.537 1.00 0.00 O ATOM 358 CB LYS A 176 -13.796 23.296 -21.018 1.00 0.00 C ATOM 359 CG LYS A 176 -12.295 23.559 -20.954 1.00 0.00 C ATOM 360 CD LYS A 176 -11.648 22.783 -19.804 1.00 0.00 C ATOM 361 CE LYS A 176 -10.290 23.352 -19.431 1.00 0.00 C ATOM 362 NZ LYS A 176 -9.735 22.648 -18.229 1.00 0.00 N ATOM 0 H LYS A 176 -12.848 20.526 -22.137 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.743 21.280 -20.290 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.212 23.835 -21.869 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -14.263 23.706 -20.123 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -11.832 23.271 -21.897 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -12.115 24.626 -20.823 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -12.304 22.809 -18.934 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -11.538 21.737 -20.089 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -9.603 23.247 -20.270 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -10.381 24.418 -19.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -8.734 22.902 -18.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -10.268 22.934 -17.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -9.818 21.620 -18.360 1.00 0.00 H new ATOM 376 N ARG A 177 -16.160 20.505 -21.571 1.00 0.00 N ATOM 377 CA ARG A 177 -17.579 20.147 -21.541 1.00 0.00 C ATOM 378 C ARG A 177 -17.633 18.636 -21.648 1.00 0.00 C ATOM 379 O ARG A 177 -16.806 18.043 -22.329 1.00 0.00 O ATOM 380 CB ARG A 177 -18.341 20.803 -22.708 1.00 0.00 C ATOM 381 CG ARG A 177 -17.780 20.465 -24.078 1.00 0.00 C ATOM 382 CD ARG A 177 -18.473 21.198 -25.195 1.00 0.00 C ATOM 383 NE ARG A 177 -17.772 20.909 -26.454 1.00 0.00 N ATOM 384 CZ ARG A 177 -17.237 21.803 -27.276 1.00 0.00 C ATOM 385 NH1 ARG A 177 -17.287 23.093 -27.053 1.00 0.00 N ATOM 386 NH2 ARG A 177 -16.630 21.377 -28.344 1.00 0.00 N ATOM 0 H ARG A 177 -15.571 19.805 -22.022 1.00 0.00 H new ATOM 0 HA ARG A 177 -18.053 20.499 -20.625 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -19.385 20.492 -22.667 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -18.325 21.885 -22.577 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -16.717 20.705 -24.098 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -17.868 19.392 -24.246 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -19.515 20.886 -25.262 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -18.473 22.270 -25.000 1.00 0.00 H new ATOM 0 HE ARG A 177 -17.689 19.928 -26.721 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -17.752 23.449 -26.218 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -16.861 23.742 -27.715 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -16.574 20.376 -28.534 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -16.210 22.043 -28.992 1.00 0.00 H new ATOM 400 N LEU A 178 -18.590 18.018 -20.977 1.00 0.00 N ATOM 401 CA LEU A 178 -18.781 16.570 -21.054 1.00 0.00 C ATOM 402 C LEU A 178 -20.265 16.275 -21.047 1.00 0.00 C ATOM 403 O LEU A 178 -21.046 17.010 -20.459 1.00 0.00 O ATOM 404 CB LEU A 178 -18.137 15.851 -19.862 1.00 0.00 C ATOM 405 CG LEU A 178 -16.613 15.639 -19.860 1.00 0.00 C ATOM 406 CD1 LEU A 178 -16.262 14.750 -18.699 1.00 0.00 C ATOM 407 CD2 LEU A 178 -16.115 14.979 -21.155 1.00 0.00 C ATOM 0 H LEU A 178 -19.254 18.496 -20.367 1.00 0.00 H new ATOM 0 HA LEU A 178 -18.309 16.212 -21.969 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -18.394 16.409 -18.962 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -18.607 14.871 -19.774 1.00 0.00 H new ATOM 0 HG LEU A 178 -16.134 16.615 -19.780 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -15.185 14.586 -18.679 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.574 15.225 -17.769 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.772 13.793 -18.806 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -15.034 14.851 -21.105 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.591 14.006 -21.274 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.367 15.612 -22.006 1.00 0.00 H new ATOM 419 N THR A 179 -20.663 15.193 -21.686 1.00 0.00 N ATOM 420 CA THR A 179 -22.057 14.773 -21.653 1.00 0.00 C ATOM 421 C THR A 179 -22.275 14.028 -20.340 1.00 0.00 C ATOM 422 O THR A 179 -21.320 13.672 -19.652 1.00 0.00 O ATOM 423 CB THR A 179 -22.405 13.856 -22.835 1.00 0.00 C ATOM 424 OG1 THR A 179 -21.532 12.726 -22.834 1.00 0.00 O ATOM 425 CG2 THR A 179 -22.244 14.596 -24.151 1.00 0.00 C ATOM 0 H THR A 179 -20.048 14.589 -22.232 1.00 0.00 H new ATOM 0 HA THR A 179 -22.702 15.648 -21.728 1.00 0.00 H new ATOM 0 HB THR A 179 -23.441 13.534 -22.729 1.00 0.00 H new ATOM 0 HG1 THR A 179 -20.640 13.001 -23.132 1.00 0.00 H new ATOM 0 HG21 THR A 179 -22.495 13.930 -24.976 1.00 0.00 H new ATOM 0 HG22 THR A 179 -22.909 15.459 -24.167 1.00 0.00 H new ATOM 0 HG23 THR A 179 -21.212 14.931 -24.256 1.00 0.00 H new ATOM 433 N LEU A 180 -23.529 13.801 -19.979 1.00 0.00 N ATOM 434 CA LEU A 180 -23.848 13.152 -18.704 1.00 0.00 C ATOM 435 C LEU A 180 -23.198 11.770 -18.558 1.00 0.00 C ATOM 436 O LEU A 180 -22.715 11.418 -17.485 1.00 0.00 O ATOM 437 CB LEU A 180 -25.370 13.040 -18.559 1.00 0.00 C ATOM 438 CG LEU A 180 -25.893 12.520 -17.210 1.00 0.00 C ATOM 439 CD1 LEU A 180 -25.424 13.383 -16.036 1.00 0.00 C ATOM 440 CD2 LEU A 180 -27.423 12.488 -17.242 1.00 0.00 C ATOM 0 H LEU A 180 -24.341 14.052 -20.542 1.00 0.00 H new ATOM 0 HA LEU A 180 -23.437 13.773 -17.908 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -25.803 14.024 -18.737 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -25.740 12.382 -19.345 1.00 0.00 H new ATOM 0 HG LEU A 180 -25.491 11.518 -17.061 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -25.819 12.976 -15.105 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -24.335 13.385 -15.998 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -25.784 14.403 -16.168 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -27.799 12.120 -16.288 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -27.804 13.494 -17.419 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -27.756 11.828 -18.042 1.00 0.00 H new ATOM 452 N SER A 181 -23.176 11.002 -19.636 1.00 0.00 N ATOM 453 CA SER A 181 -22.577 9.670 -19.625 1.00 0.00 C ATOM 454 C SER A 181 -21.073 9.744 -19.402 1.00 0.00 C ATOM 455 O SER A 181 -20.506 8.958 -18.656 1.00 0.00 O ATOM 456 CB SER A 181 -22.845 9.011 -20.972 1.00 0.00 C ATOM 457 OG SER A 181 -23.215 10.009 -21.915 1.00 0.00 O ATOM 0 H SER A 181 -23.568 11.278 -20.537 1.00 0.00 H new ATOM 0 HA SER A 181 -23.016 9.093 -18.811 1.00 0.00 H new ATOM 0 HB2 SER A 181 -21.956 8.482 -21.315 1.00 0.00 H new ATOM 0 HB3 SER A 181 -23.640 8.271 -20.877 1.00 0.00 H new ATOM 0 HG SER A 181 -23.387 9.590 -22.784 1.00 0.00 H new ATOM 463 N GLN A 182 -20.436 10.704 -20.050 1.00 0.00 N ATOM 464 CA GLN A 182 -18.988 10.868 -19.968 1.00 0.00 C ATOM 465 C GLN A 182 -18.510 11.197 -18.563 1.00 0.00 C ATOM 466 O GLN A 182 -17.432 10.787 -18.153 1.00 0.00 O ATOM 467 CB GLN A 182 -18.569 11.975 -20.915 1.00 0.00 C ATOM 468 CG GLN A 182 -18.373 11.492 -22.348 1.00 0.00 C ATOM 469 CD GLN A 182 -18.156 12.634 -23.313 1.00 0.00 C ATOM 470 OE1 GLN A 182 -18.880 13.623 -23.288 1.00 0.00 O ATOM 471 NE2 GLN A 182 -17.172 12.513 -24.160 1.00 0.00 N ATOM 0 H GLN A 182 -20.901 11.390 -20.645 1.00 0.00 H new ATOM 0 HA GLN A 182 -18.531 9.918 -20.245 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -19.324 12.761 -20.903 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -17.640 12.419 -20.557 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -17.517 10.818 -22.388 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -19.246 10.918 -22.658 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -16.591 11.675 -24.150 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -16.983 13.257 -24.832 1.00 0.00 H new ATOM 480 N ILE A 183 -19.316 11.929 -17.816 1.00 0.00 N ATOM 481 CA ILE A 183 -18.978 12.269 -16.438 1.00 0.00 C ATOM 482 C ILE A 183 -18.954 10.983 -15.610 1.00 0.00 C ATOM 483 O ILE A 183 -18.102 10.816 -14.731 1.00 0.00 O ATOM 484 CB ILE A 183 -19.999 13.288 -15.885 1.00 0.00 C ATOM 485 CG1 ILE A 183 -19.861 14.599 -16.678 1.00 0.00 C ATOM 486 CG2 ILE A 183 -19.788 13.561 -14.375 1.00 0.00 C ATOM 487 CD1 ILE A 183 -21.100 15.423 -16.714 1.00 0.00 C ATOM 0 H ILE A 183 -20.210 12.301 -18.136 1.00 0.00 H new ATOM 0 HA ILE A 183 -17.993 12.734 -16.387 1.00 0.00 H new ATOM 0 HB ILE A 183 -21.000 12.872 -15.999 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -19.057 15.191 -16.242 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -19.565 14.363 -17.700 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -20.528 14.283 -14.029 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -19.900 12.631 -13.818 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -18.787 13.962 -14.214 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -20.918 16.329 -17.292 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -21.904 14.852 -17.178 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -21.387 15.693 -15.698 1.00 0.00 H new ATOM 499 N TYR A 184 -19.865 10.063 -15.897 1.00 0.00 N ATOM 500 CA TYR A 184 -19.877 8.786 -15.188 1.00 0.00 C ATOM 501 C TYR A 184 -18.616 7.997 -15.532 1.00 0.00 C ATOM 502 O TYR A 184 -17.929 7.490 -14.649 1.00 0.00 O ATOM 503 CB TYR A 184 -21.105 7.936 -15.549 1.00 0.00 C ATOM 504 CG TYR A 184 -22.461 8.592 -15.330 1.00 0.00 C ATOM 505 CD1 TYR A 184 -22.659 9.569 -14.330 1.00 0.00 C ATOM 506 CD2 TYR A 184 -23.564 8.224 -16.127 1.00 0.00 C ATOM 507 CE1 TYR A 184 -23.943 10.148 -14.120 1.00 0.00 C ATOM 508 CE2 TYR A 184 -24.843 8.802 -15.918 1.00 0.00 C ATOM 509 CZ TYR A 184 -25.018 9.751 -14.910 1.00 0.00 C ATOM 510 OH TYR A 184 -26.261 10.293 -14.701 1.00 0.00 O ATOM 0 H TYR A 184 -20.594 10.171 -16.602 1.00 0.00 H new ATOM 0 HA TYR A 184 -19.916 9.007 -14.121 1.00 0.00 H new ATOM 0 HB2 TYR A 184 -21.028 7.650 -16.598 1.00 0.00 H new ATOM 0 HB3 TYR A 184 -21.070 7.017 -14.964 1.00 0.00 H new ATOM 0 HD1 TYR A 184 -21.826 9.881 -13.717 1.00 0.00 H new ATOM 0 HD2 TYR A 184 -23.434 7.491 -16.909 1.00 0.00 H new ATOM 0 HE1 TYR A 184 -24.082 10.893 -13.350 1.00 0.00 H new ATOM 0 HE2 TYR A 184 -25.678 8.508 -16.537 1.00 0.00 H new ATOM 0 HH TYR A 184 -26.897 9.908 -15.339 1.00 0.00 H new ATOM 520 N GLU A 185 -18.313 7.909 -16.820 1.00 0.00 N ATOM 521 CA GLU A 185 -17.140 7.170 -17.295 1.00 0.00 C ATOM 522 C GLU A 185 -15.857 7.732 -16.692 1.00 0.00 C ATOM 523 O GLU A 185 -14.944 6.985 -16.334 1.00 0.00 O ATOM 524 CB GLU A 185 -17.056 7.249 -18.823 1.00 0.00 C ATOM 525 CG GLU A 185 -18.185 6.526 -19.545 1.00 0.00 C ATOM 526 CD GLU A 185 -18.149 6.765 -21.048 1.00 0.00 C ATOM 527 OE1 GLU A 185 -18.455 7.900 -21.482 1.00 0.00 O ATOM 528 OE2 GLU A 185 -17.809 5.826 -21.793 1.00 0.00 O ATOM 0 H GLU A 185 -18.864 8.341 -17.562 1.00 0.00 H new ATOM 0 HA GLU A 185 -17.248 6.131 -16.983 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -17.060 8.297 -19.123 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -16.104 6.828 -19.146 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -18.115 5.456 -19.347 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -19.143 6.862 -19.148 1.00 0.00 H new ATOM 535 N TRP A 186 -15.783 9.050 -16.566 1.00 0.00 N ATOM 536 CA TRP A 186 -14.610 9.692 -15.997 1.00 0.00 C ATOM 537 C TRP A 186 -14.415 9.280 -14.546 1.00 0.00 C ATOM 538 O TRP A 186 -13.291 9.040 -14.123 1.00 0.00 O ATOM 539 CB TRP A 186 -14.738 11.213 -16.086 1.00 0.00 C ATOM 540 CG TRP A 186 -13.549 11.928 -15.508 1.00 0.00 C ATOM 541 CD1 TRP A 186 -12.443 12.358 -16.163 1.00 0.00 C ATOM 542 CD2 TRP A 186 -13.343 12.304 -14.129 1.00 0.00 C ATOM 543 NE1 TRP A 186 -11.564 12.968 -15.316 1.00 0.00 N ATOM 544 CE2 TRP A 186 -12.074 12.944 -14.052 1.00 0.00 C ATOM 545 CE3 TRP A 186 -14.105 12.172 -12.956 1.00 0.00 C ATOM 546 CZ2 TRP A 186 -11.549 13.436 -12.844 1.00 0.00 C ATOM 547 CZ3 TRP A 186 -13.585 12.665 -11.734 1.00 0.00 C ATOM 548 CH2 TRP A 186 -12.305 13.293 -11.693 1.00 0.00 C ATOM 0 H TRP A 186 -16.522 9.693 -16.850 1.00 0.00 H new ATOM 0 HA TRP A 186 -13.741 9.371 -16.571 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -14.860 11.503 -17.130 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -15.639 11.530 -15.560 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -12.278 12.233 -17.223 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -10.669 13.376 -15.585 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -15.076 11.700 -12.986 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -10.581 13.913 -12.815 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -14.162 12.565 -10.827 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -11.921 13.661 -10.753 1.00 0.00 H new ATOM 559 N MET A 187 -15.489 9.183 -13.775 1.00 0.00 N ATOM 560 CA MET A 187 -15.352 8.808 -12.365 1.00 0.00 C ATOM 561 C MET A 187 -14.942 7.346 -12.229 1.00 0.00 C ATOM 562 O MET A 187 -14.178 7.009 -11.335 1.00 0.00 O ATOM 563 CB MET A 187 -16.640 9.073 -11.590 1.00 0.00 C ATOM 564 CG MET A 187 -16.933 10.540 -11.393 1.00 0.00 C ATOM 565 SD MET A 187 -18.304 10.807 -10.270 1.00 0.00 S ATOM 566 CE MET A 187 -18.669 12.500 -10.624 1.00 0.00 C ATOM 0 H MET A 187 -16.445 9.353 -14.087 1.00 0.00 H new ATOM 0 HA MET A 187 -14.567 9.430 -11.936 1.00 0.00 H new ATOM 0 HB2 MET A 187 -17.474 8.612 -12.119 1.00 0.00 H new ATOM 0 HB3 MET A 187 -16.574 8.590 -10.615 1.00 0.00 H new ATOM 0 HG2 MET A 187 -16.044 11.038 -11.005 1.00 0.00 H new ATOM 0 HG3 MET A 187 -17.159 10.997 -12.356 1.00 0.00 H new ATOM 0 HE1 MET A 187 -19.024 12.993 -9.719 1.00 0.00 H new ATOM 0 HE2 MET A 187 -17.768 13.000 -10.980 1.00 0.00 H new ATOM 0 HE3 MET A 187 -19.441 12.553 -11.392 1.00 0.00 H new ATOM 576 N VAL A 188 -15.419 6.485 -13.117 1.00 0.00 N ATOM 577 CA VAL A 188 -15.015 5.071 -13.102 1.00 0.00 C ATOM 578 C VAL A 188 -13.517 4.985 -13.422 1.00 0.00 C ATOM 579 O VAL A 188 -12.777 4.209 -12.817 1.00 0.00 O ATOM 580 CB VAL A 188 -15.833 4.240 -14.150 1.00 0.00 C ATOM 581 CG1 VAL A 188 -15.316 2.799 -14.260 1.00 0.00 C ATOM 582 CG2 VAL A 188 -17.316 4.205 -13.765 1.00 0.00 C ATOM 0 H VAL A 188 -16.081 6.730 -13.854 1.00 0.00 H new ATOM 0 HA VAL A 188 -15.215 4.654 -12.115 1.00 0.00 H new ATOM 0 HB VAL A 188 -15.709 4.731 -15.115 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -15.908 2.255 -14.996 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -14.271 2.810 -14.571 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -15.401 2.307 -13.291 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -17.870 3.624 -14.503 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -17.426 3.744 -12.783 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -17.708 5.222 -13.735 1.00 0.00 H new ATOM 592 N LYS A 189 -13.069 5.797 -14.369 1.00 0.00 N ATOM 593 CA LYS A 189 -11.662 5.812 -14.771 1.00 0.00 C ATOM 594 C LYS A 189 -10.720 6.448 -13.754 1.00 0.00 C ATOM 595 O LYS A 189 -9.599 5.984 -13.585 1.00 0.00 O ATOM 596 CB LYS A 189 -11.523 6.590 -16.085 1.00 0.00 C ATOM 597 CG LYS A 189 -11.595 5.720 -17.346 1.00 0.00 C ATOM 598 CD LYS A 189 -10.294 4.922 -17.598 1.00 0.00 C ATOM 599 CE LYS A 189 -9.125 5.813 -18.063 1.00 0.00 C ATOM 600 NZ LYS A 189 -9.392 6.452 -19.404 1.00 0.00 N ATOM 0 H LYS A 189 -13.658 6.457 -14.877 1.00 0.00 H new ATOM 0 HA LYS A 189 -11.372 4.766 -14.868 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -12.310 7.343 -16.132 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -10.572 7.122 -16.079 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -12.430 5.025 -17.256 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -11.800 6.354 -18.208 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -10.008 4.404 -16.682 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -10.483 4.157 -18.351 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -8.946 6.591 -17.321 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -8.216 5.215 -18.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -8.513 6.872 -19.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -9.735 5.731 -20.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -10.112 7.195 -19.297 1.00 0.00 H new ATOM 614 N SER A 190 -11.157 7.522 -13.116 1.00 0.00 N ATOM 615 CA SER A 190 -10.290 8.300 -12.234 1.00 0.00 C ATOM 616 C SER A 190 -10.409 8.039 -10.738 1.00 0.00 C ATOM 617 O SER A 190 -9.536 8.446 -9.978 1.00 0.00 O ATOM 618 CB SER A 190 -10.575 9.780 -12.470 1.00 0.00 C ATOM 619 OG SER A 190 -10.621 10.058 -13.860 1.00 0.00 O ATOM 0 H SER A 190 -12.110 7.879 -13.190 1.00 0.00 H new ATOM 0 HA SER A 190 -9.280 7.987 -12.497 1.00 0.00 H new ATOM 0 HB2 SER A 190 -11.523 10.053 -12.006 1.00 0.00 H new ATOM 0 HB3 SER A 190 -9.802 10.386 -11.997 1.00 0.00 H new ATOM 0 HG SER A 190 -11.068 10.918 -14.007 1.00 0.00 H new ATOM 625 N VAL A 191 -11.477 7.385 -10.297 1.00 0.00 N ATOM 626 CA VAL A 191 -11.677 7.148 -8.865 1.00 0.00 C ATOM 627 C VAL A 191 -11.946 5.664 -8.608 1.00 0.00 C ATOM 628 O VAL A 191 -12.941 5.114 -9.086 1.00 0.00 O ATOM 629 CB VAL A 191 -12.858 7.999 -8.309 1.00 0.00 C ATOM 630 CG1 VAL A 191 -12.963 7.848 -6.794 1.00 0.00 C ATOM 631 CG2 VAL A 191 -12.658 9.470 -8.634 1.00 0.00 C ATOM 0 H VAL A 191 -12.212 7.012 -10.898 1.00 0.00 H new ATOM 0 HA VAL A 191 -10.766 7.448 -8.348 1.00 0.00 H new ATOM 0 HB VAL A 191 -13.773 7.639 -8.780 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -13.793 8.450 -6.425 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -13.134 6.801 -6.544 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -12.036 8.185 -6.330 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -13.493 10.047 -8.237 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -11.729 9.819 -8.183 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -12.608 9.600 -9.715 1.00 0.00 H new ATOM 641 N PRO A 192 -11.072 4.991 -7.835 1.00 0.00 N ATOM 642 CA PRO A 192 -11.321 3.557 -7.636 1.00 0.00 C ATOM 643 C PRO A 192 -12.584 3.276 -6.825 1.00 0.00 C ATOM 644 O PRO A 192 -13.191 2.225 -6.969 1.00 0.00 O ATOM 645 CB PRO A 192 -10.055 3.083 -6.913 1.00 0.00 C ATOM 646 CG PRO A 192 -9.567 4.286 -6.191 1.00 0.00 C ATOM 647 CD PRO A 192 -9.852 5.432 -7.129 1.00 0.00 C ATOM 0 HA PRO A 192 -11.503 3.034 -8.575 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -10.273 2.268 -6.223 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -9.310 2.714 -7.618 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -10.083 4.414 -5.240 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -8.503 4.211 -5.969 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -10.014 6.365 -6.589 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -9.026 5.603 -7.819 1.00 0.00 H new ATOM 655 N TYR A 193 -12.993 4.234 -5.999 1.00 0.00 N ATOM 656 CA TYR A 193 -14.231 4.110 -5.232 1.00 0.00 C ATOM 657 C TYR A 193 -15.404 3.902 -6.176 1.00 0.00 C ATOM 658 O TYR A 193 -16.237 3.053 -5.951 1.00 0.00 O ATOM 659 CB TYR A 193 -14.485 5.384 -4.411 1.00 0.00 C ATOM 660 CG TYR A 193 -15.817 5.391 -3.687 1.00 0.00 C ATOM 661 CD1 TYR A 193 -16.955 5.980 -4.285 1.00 0.00 C ATOM 662 CD2 TYR A 193 -15.953 4.827 -2.404 1.00 0.00 C ATOM 663 CE1 TYR A 193 -18.204 5.994 -3.620 1.00 0.00 C ATOM 664 CE2 TYR A 193 -17.207 4.850 -1.728 1.00 0.00 C ATOM 665 CZ TYR A 193 -18.319 5.429 -2.349 1.00 0.00 C ATOM 666 OH TYR A 193 -19.535 5.434 -1.714 1.00 0.00 O ATOM 0 H TYR A 193 -12.486 5.105 -5.843 1.00 0.00 H new ATOM 0 HA TYR A 193 -14.132 3.257 -4.561 1.00 0.00 H new ATOM 0 HB2 TYR A 193 -13.684 5.500 -3.680 1.00 0.00 H new ATOM 0 HB3 TYR A 193 -14.438 6.248 -5.074 1.00 0.00 H new ATOM 0 HD1 TYR A 193 -16.870 6.426 -5.265 1.00 0.00 H new ATOM 0 HD2 TYR A 193 -15.097 4.372 -1.927 1.00 0.00 H new ATOM 0 HE1 TYR A 193 -19.065 6.440 -4.094 1.00 0.00 H new ATOM 0 HE2 TYR A 193 -17.299 4.422 -0.741 1.00 0.00 H new ATOM 0 HH TYR A 193 -19.449 5.002 -0.838 1.00 0.00 H new ATOM 676 N PHE A 194 -15.476 4.692 -7.233 1.00 0.00 N ATOM 677 CA PHE A 194 -16.604 4.608 -8.149 1.00 0.00 C ATOM 678 C PHE A 194 -16.453 3.477 -9.143 1.00 0.00 C ATOM 679 O PHE A 194 -17.445 2.971 -9.652 1.00 0.00 O ATOM 680 CB PHE A 194 -16.775 5.933 -8.879 1.00 0.00 C ATOM 681 CG PHE A 194 -17.573 6.931 -8.102 1.00 0.00 C ATOM 682 CD1 PHE A 194 -18.970 6.790 -8.004 1.00 0.00 C ATOM 683 CD2 PHE A 194 -16.947 8.009 -7.454 1.00 0.00 C ATOM 684 CE1 PHE A 194 -19.741 7.704 -7.265 1.00 0.00 C ATOM 685 CE2 PHE A 194 -17.704 8.929 -6.697 1.00 0.00 C ATOM 686 CZ PHE A 194 -19.099 8.776 -6.598 1.00 0.00 C ATOM 0 H PHE A 194 -14.776 5.392 -7.478 1.00 0.00 H new ATOM 0 HA PHE A 194 -17.494 4.397 -7.557 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -15.792 6.352 -9.095 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -17.263 5.753 -9.837 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -19.457 5.966 -8.505 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -15.877 8.135 -7.536 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -20.813 7.590 -7.206 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -17.213 9.749 -6.195 1.00 0.00 H new ATOM 0 HZ PHE A 194 -19.680 9.475 -6.014 1.00 0.00 H new ATOM 696 N LYS A 195 -15.222 3.061 -9.398 1.00 0.00 N ATOM 697 CA LYS A 195 -14.978 1.904 -10.256 1.00 0.00 C ATOM 698 C LYS A 195 -15.591 0.677 -9.587 1.00 0.00 C ATOM 699 O LYS A 195 -16.229 -0.143 -10.230 1.00 0.00 O ATOM 700 CB LYS A 195 -13.475 1.708 -10.460 1.00 0.00 C ATOM 701 CG LYS A 195 -13.132 0.644 -11.483 1.00 0.00 C ATOM 702 CD LYS A 195 -11.630 0.443 -11.562 1.00 0.00 C ATOM 703 CE LYS A 195 -11.290 -0.637 -12.580 1.00 0.00 C ATOM 704 NZ LYS A 195 -9.817 -0.932 -12.595 1.00 0.00 N ATOM 0 H LYS A 195 -14.380 3.501 -9.028 1.00 0.00 H new ATOM 0 HA LYS A 195 -15.432 2.058 -11.235 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -13.033 2.655 -10.771 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -13.020 1.442 -9.506 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -13.616 -0.295 -11.215 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -13.517 0.934 -12.460 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -11.146 1.379 -11.841 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -11.242 0.163 -10.582 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -11.842 -1.547 -12.346 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -11.609 -0.317 -13.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -9.618 -1.672 -13.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -9.293 -0.069 -12.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -9.519 -1.260 -11.654 1.00 0.00 H new ATOM 718 N ASP A 196 -15.400 0.589 -8.280 1.00 0.00 N ATOM 719 CA ASP A 196 -15.966 -0.488 -7.462 1.00 0.00 C ATOM 720 C ASP A 196 -17.497 -0.420 -7.445 1.00 0.00 C ATOM 721 O ASP A 196 -18.180 -1.426 -7.335 1.00 0.00 O ATOM 722 CB ASP A 196 -15.433 -0.337 -6.032 1.00 0.00 C ATOM 723 CG ASP A 196 -16.015 -1.358 -5.075 1.00 0.00 C ATOM 724 OD1 ASP A 196 -15.735 -2.557 -5.236 1.00 0.00 O ATOM 725 OD2 ASP A 196 -16.750 -0.941 -4.146 1.00 0.00 O ATOM 0 H ASP A 196 -14.847 1.262 -7.749 1.00 0.00 H new ATOM 0 HA ASP A 196 -15.675 -1.450 -7.885 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -14.347 -0.434 -6.042 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -15.661 0.665 -5.669 1.00 0.00 H new ATOM 730 N LYS A 197 -18.044 0.783 -7.569 1.00 0.00 N ATOM 731 CA LYS A 197 -19.501 0.977 -7.473 1.00 0.00 C ATOM 732 C LYS A 197 -20.177 0.801 -8.819 1.00 0.00 C ATOM 733 O LYS A 197 -21.294 1.262 -9.017 1.00 0.00 O ATOM 734 CB LYS A 197 -19.846 2.372 -6.910 1.00 0.00 C ATOM 735 CG LYS A 197 -19.352 2.707 -5.485 1.00 0.00 C ATOM 736 CD LYS A 197 -18.805 1.515 -4.685 1.00 0.00 C ATOM 737 CE LYS A 197 -18.458 1.849 -3.258 1.00 0.00 C ATOM 738 NZ LYS A 197 -19.639 1.708 -2.362 1.00 0.00 N ATOM 0 H LYS A 197 -17.513 1.638 -7.735 1.00 0.00 H new ATOM 0 HA LYS A 197 -19.873 0.214 -6.789 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -19.440 3.120 -7.591 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -20.930 2.482 -6.925 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -18.571 3.464 -5.557 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -20.176 3.151 -4.927 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -19.545 0.715 -4.691 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -17.916 1.131 -5.185 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -17.658 1.193 -2.914 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -18.079 2.869 -3.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -19.365 1.945 -1.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -20.392 2.352 -2.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -19.985 0.728 -2.396 1.00 0.00 H new ATOM 752 N GLY A 198 -19.499 0.136 -9.734 1.00 0.00 N ATOM 753 CA GLY A 198 -20.026 -0.085 -11.078 1.00 0.00 C ATOM 754 C GLY A 198 -21.159 -1.100 -11.178 1.00 0.00 C ATOM 755 O GLY A 198 -21.608 -1.422 -12.272 1.00 0.00 O ATOM 0 H GLY A 198 -18.575 -0.265 -9.575 1.00 0.00 H new ATOM 0 HA2 GLY A 198 -20.379 0.868 -11.473 1.00 0.00 H new ATOM 0 HA3 GLY A 198 -19.209 -0.413 -11.721 1.00 0.00 H new ATOM 759 N ASP A 199 -21.622 -1.605 -10.043 1.00 0.00 N ATOM 760 CA ASP A 199 -22.724 -2.567 -10.001 1.00 0.00 C ATOM 761 C ASP A 199 -24.041 -1.992 -10.571 1.00 0.00 C ATOM 762 O ASP A 199 -24.333 -0.793 -10.463 1.00 0.00 O ATOM 763 CB ASP A 199 -22.934 -3.024 -8.552 1.00 0.00 C ATOM 764 CG ASP A 199 -24.354 -3.471 -8.285 1.00 0.00 C ATOM 765 OD1 ASP A 199 -25.028 -2.793 -7.493 1.00 0.00 O ATOM 766 OD2 ASP A 199 -24.814 -4.468 -8.879 1.00 0.00 O ATOM 0 H ASP A 199 -21.248 -1.363 -9.125 1.00 0.00 H new ATOM 0 HA ASP A 199 -22.452 -3.412 -10.633 1.00 0.00 H new ATOM 0 HB2 ASP A 199 -22.251 -3.844 -8.331 1.00 0.00 H new ATOM 0 HB3 ASP A 199 -22.681 -2.207 -7.877 1.00 0.00 H new ATOM 771 N SER A 200 -24.836 -2.866 -11.172 1.00 0.00 N ATOM 772 CA SER A 200 -26.108 -2.492 -11.781 1.00 0.00 C ATOM 773 C SER A 200 -27.099 -1.832 -10.811 1.00 0.00 C ATOM 774 O SER A 200 -27.762 -0.862 -11.177 1.00 0.00 O ATOM 775 CB SER A 200 -26.755 -3.737 -12.392 1.00 0.00 C ATOM 776 OG SER A 200 -27.067 -4.700 -11.396 1.00 0.00 O ATOM 0 H SER A 200 -24.617 -3.859 -11.252 1.00 0.00 H new ATOM 0 HA SER A 200 -25.879 -1.744 -12.540 1.00 0.00 H new ATOM 0 HB2 SER A 200 -27.663 -3.453 -12.923 1.00 0.00 H new ATOM 0 HB3 SER A 200 -26.080 -4.176 -13.127 1.00 0.00 H new ATOM 0 HG SER A 200 -27.480 -5.483 -11.816 1.00 0.00 H new ATOM 782 N ASN A 201 -27.221 -2.325 -9.586 1.00 0.00 N ATOM 783 CA ASN A 201 -28.165 -1.724 -8.638 1.00 0.00 C ATOM 784 C ASN A 201 -27.612 -0.392 -8.129 1.00 0.00 C ATOM 785 O ASN A 201 -28.350 0.585 -7.954 1.00 0.00 O ATOM 786 CB ASN A 201 -28.450 -2.675 -7.467 1.00 0.00 C ATOM 787 CG ASN A 201 -29.159 -3.938 -7.903 1.00 0.00 C ATOM 788 OD1 ASN A 201 -28.713 -5.031 -7.631 1.00 0.00 O ATOM 789 ND2 ASN A 201 -30.273 -3.788 -8.571 1.00 0.00 N ATOM 0 H ASN A 201 -26.694 -3.121 -9.226 1.00 0.00 H new ATOM 0 HA ASN A 201 -29.107 -1.542 -9.155 1.00 0.00 H new ATOM 0 HB2 ASN A 201 -27.511 -2.939 -6.981 1.00 0.00 H new ATOM 0 HB3 ASN A 201 -29.059 -2.159 -6.724 1.00 0.00 H new ATOM 0 HD21 ASN A 201 -30.796 -4.607 -8.881 1.00 0.00 H new ATOM 0 HD22 ASN A 201 -30.619 -2.852 -8.782 1.00 0.00 H new ATOM 796 N SER A 202 -26.304 -0.354 -7.913 1.00 0.00 N ATOM 797 CA SER A 202 -25.588 0.847 -7.471 1.00 0.00 C ATOM 798 C SER A 202 -25.785 2.003 -8.448 1.00 0.00 C ATOM 799 O SER A 202 -25.742 3.183 -8.060 1.00 0.00 O ATOM 800 CB SER A 202 -24.096 0.524 -7.353 1.00 0.00 C ATOM 801 OG SER A 202 -23.327 1.679 -7.078 1.00 0.00 O ATOM 0 H SER A 202 -25.698 -1.164 -8.040 1.00 0.00 H new ATOM 0 HA SER A 202 -25.988 1.152 -6.504 1.00 0.00 H new ATOM 0 HB2 SER A 202 -23.945 -0.210 -6.561 1.00 0.00 H new ATOM 0 HB3 SER A 202 -23.749 0.069 -8.280 1.00 0.00 H new ATOM 0 HG SER A 202 -22.645 1.791 -7.773 1.00 0.00 H new ATOM 807 N SER A 203 -26.031 1.672 -9.708 1.00 0.00 N ATOM 808 CA SER A 203 -26.257 2.674 -10.750 1.00 0.00 C ATOM 809 C SER A 203 -27.386 3.642 -10.371 1.00 0.00 C ATOM 810 O SER A 203 -27.359 4.816 -10.751 1.00 0.00 O ATOM 811 CB SER A 203 -26.573 1.999 -12.082 1.00 0.00 C ATOM 812 OG SER A 203 -25.482 1.200 -12.513 1.00 0.00 O ATOM 0 H SER A 203 -26.080 0.709 -10.039 1.00 0.00 H new ATOM 0 HA SER A 203 -25.339 3.252 -10.851 1.00 0.00 H new ATOM 0 HB2 SER A 203 -27.464 1.380 -11.979 1.00 0.00 H new ATOM 0 HB3 SER A 203 -26.795 2.755 -12.835 1.00 0.00 H new ATOM 0 HG SER A 203 -25.262 0.544 -11.819 1.00 0.00 H new ATOM 818 N ALA A 204 -28.371 3.173 -9.613 1.00 0.00 N ATOM 819 CA ALA A 204 -29.476 4.027 -9.180 1.00 0.00 C ATOM 820 C ALA A 204 -28.989 5.218 -8.326 1.00 0.00 C ATOM 821 O ALA A 204 -29.456 6.351 -8.502 1.00 0.00 O ATOM 822 CB ALA A 204 -30.496 3.192 -8.395 1.00 0.00 C ATOM 0 H ALA A 204 -28.429 2.209 -9.285 1.00 0.00 H new ATOM 0 HA ALA A 204 -29.947 4.441 -10.071 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -31.319 3.831 -8.073 1.00 0.00 H new ATOM 0 HB2 ALA A 204 -30.882 2.396 -9.032 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -30.013 2.755 -7.521 1.00 0.00 H new ATOM 828 N GLY A 205 -28.053 4.972 -7.418 1.00 0.00 N ATOM 829 CA GLY A 205 -27.544 6.037 -6.560 1.00 0.00 C ATOM 830 C GLY A 205 -26.500 6.870 -7.273 1.00 0.00 C ATOM 831 O GLY A 205 -26.354 8.074 -7.025 1.00 0.00 O ATOM 0 H GLY A 205 -27.634 4.056 -7.257 1.00 0.00 H new ATOM 0 HA2 GLY A 205 -28.368 6.677 -6.244 1.00 0.00 H new ATOM 0 HA3 GLY A 205 -27.112 5.604 -5.658 1.00 0.00 H new ATOM 835 N TRP A 206 -25.789 6.219 -8.181 1.00 0.00 N ATOM 836 CA TRP A 206 -24.740 6.834 -8.993 1.00 0.00 C ATOM 837 C TRP A 206 -25.281 8.038 -9.761 1.00 0.00 C ATOM 838 O TRP A 206 -24.811 9.173 -9.609 1.00 0.00 O ATOM 839 CB TRP A 206 -24.338 5.784 -10.026 1.00 0.00 C ATOM 840 CG TRP A 206 -22.962 5.328 -10.070 1.00 0.00 C ATOM 841 CD1 TRP A 206 -22.490 4.133 -9.653 1.00 0.00 C ATOM 842 CD2 TRP A 206 -21.844 5.997 -10.666 1.00 0.00 C ATOM 843 NE1 TRP A 206 -21.175 3.985 -9.948 1.00 0.00 N ATOM 844 CE2 TRP A 206 -20.740 5.101 -10.596 1.00 0.00 C ATOM 845 CE3 TRP A 206 -21.664 7.253 -11.274 1.00 0.00 C ATOM 846 CZ2 TRP A 206 -19.491 5.410 -11.139 1.00 0.00 C ATOM 847 CZ3 TRP A 206 -20.397 7.579 -11.796 1.00 0.00 C ATOM 848 CH2 TRP A 206 -19.327 6.644 -11.735 1.00 0.00 C ATOM 0 H TRP A 206 -25.925 5.228 -8.381 1.00 0.00 H new ATOM 0 HA TRP A 206 -23.917 7.160 -8.357 1.00 0.00 H new ATOM 0 HB2 TRP A 206 -24.969 4.909 -9.868 1.00 0.00 H new ATOM 0 HB3 TRP A 206 -24.584 6.181 -11.011 1.00 0.00 H new ATOM 0 HD1 TRP A 206 -23.086 3.388 -9.147 1.00 0.00 H new ATOM 0 HE1 TRP A 206 -20.604 3.170 -9.721 1.00 0.00 H new ATOM 0 HE3 TRP A 206 -22.483 7.955 -11.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 -18.676 4.703 -11.094 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 -20.237 8.547 -12.246 1.00 0.00 H new ATOM 0 HH2 TRP A 206 -18.370 6.904 -12.162 1.00 0.00 H new ATOM 859 N LYS A 207 -26.292 7.783 -10.584 1.00 0.00 N ATOM 860 CA LYS A 207 -26.871 8.823 -11.430 1.00 0.00 C ATOM 861 C LYS A 207 -27.595 9.868 -10.619 1.00 0.00 C ATOM 862 O LYS A 207 -27.566 11.041 -10.957 1.00 0.00 O ATOM 863 CB LYS A 207 -27.813 8.209 -12.489 1.00 0.00 C ATOM 864 CG LYS A 207 -28.915 7.271 -11.950 1.00 0.00 C ATOM 865 CD LYS A 207 -30.310 7.888 -11.938 1.00 0.00 C ATOM 866 CE LYS A 207 -31.301 6.882 -11.339 1.00 0.00 C ATOM 867 NZ LYS A 207 -32.710 7.402 -11.255 1.00 0.00 N ATOM 0 H LYS A 207 -26.728 6.866 -10.684 1.00 0.00 H new ATOM 0 HA LYS A 207 -26.047 9.318 -11.943 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -28.291 9.021 -13.037 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -27.209 7.653 -13.206 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -28.935 6.366 -12.557 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -28.655 6.968 -10.936 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -30.309 8.808 -11.353 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -30.612 8.155 -12.951 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -31.293 5.974 -11.942 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -30.965 6.604 -10.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -33.325 6.672 -10.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -32.731 8.252 -10.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -33.049 7.641 -12.209 1.00 0.00 H new ATOM 881 N ASN A 208 -28.261 9.458 -9.551 1.00 0.00 N ATOM 882 CA ASN A 208 -29.057 10.399 -8.778 1.00 0.00 C ATOM 883 C ASN A 208 -28.203 11.446 -8.079 1.00 0.00 C ATOM 884 O ASN A 208 -28.564 12.615 -8.035 1.00 0.00 O ATOM 885 CB ASN A 208 -29.897 9.657 -7.745 1.00 0.00 C ATOM 886 CG ASN A 208 -30.969 10.527 -7.154 1.00 0.00 C ATOM 887 OD1 ASN A 208 -31.742 11.132 -7.875 1.00 0.00 O ATOM 888 ND2 ASN A 208 -31.030 10.589 -5.853 1.00 0.00 N ATOM 0 H ASN A 208 -28.268 8.499 -9.204 1.00 0.00 H new ATOM 0 HA ASN A 208 -29.706 10.918 -9.484 1.00 0.00 H new ATOM 0 HB2 ASN A 208 -30.355 8.785 -8.211 1.00 0.00 H new ATOM 0 HB3 ASN A 208 -29.249 9.290 -6.949 1.00 0.00 H new ATOM 0 HD21 ASN A 208 -31.745 11.160 -5.403 1.00 0.00 H new ATOM 0 HD22 ASN A 208 -30.363 10.066 -5.286 1.00 0.00 H new ATOM 895 N SER A 209 -27.075 11.032 -7.525 1.00 0.00 N ATOM 896 CA SER A 209 -26.221 11.958 -6.788 1.00 0.00 C ATOM 897 C SER A 209 -25.573 12.997 -7.701 1.00 0.00 C ATOM 898 O SER A 209 -25.502 14.181 -7.360 1.00 0.00 O ATOM 899 CB SER A 209 -25.148 11.178 -6.045 1.00 0.00 C ATOM 900 OG SER A 209 -25.741 10.201 -5.207 1.00 0.00 O ATOM 0 H SER A 209 -26.730 10.073 -7.569 1.00 0.00 H new ATOM 0 HA SER A 209 -26.850 12.497 -6.079 1.00 0.00 H new ATOM 0 HB2 SER A 209 -24.479 10.697 -6.758 1.00 0.00 H new ATOM 0 HB3 SER A 209 -24.541 11.859 -5.448 1.00 0.00 H new ATOM 0 HG SER A 209 -26.022 9.433 -5.747 1.00 0.00 H new ATOM 906 N ILE A 210 -25.110 12.568 -8.866 1.00 0.00 N ATOM 907 CA ILE A 210 -24.494 13.493 -9.819 1.00 0.00 C ATOM 908 C ILE A 210 -25.571 14.416 -10.379 1.00 0.00 C ATOM 909 O ILE A 210 -25.376 15.627 -10.461 1.00 0.00 O ATOM 910 CB ILE A 210 -23.753 12.721 -10.953 1.00 0.00 C ATOM 911 CG1 ILE A 210 -22.525 12.016 -10.339 1.00 0.00 C ATOM 912 CG2 ILE A 210 -23.372 13.653 -12.129 1.00 0.00 C ATOM 913 CD1 ILE A 210 -21.927 10.921 -11.188 1.00 0.00 C ATOM 0 H ILE A 210 -25.146 11.597 -9.176 1.00 0.00 H new ATOM 0 HA ILE A 210 -23.743 14.095 -9.308 1.00 0.00 H new ATOM 0 HB ILE A 210 -24.417 11.970 -11.381 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -21.756 12.763 -10.143 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -22.812 11.593 -9.376 1.00 0.00 H new ATOM 0 HG21 ILE A 210 -22.858 13.077 -12.898 1.00 0.00 H new ATOM 0 HG22 ILE A 210 -24.275 14.095 -12.550 1.00 0.00 H new ATOM 0 HG23 ILE A 210 -22.715 14.444 -11.768 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -21.071 10.487 -10.672 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -22.675 10.148 -11.364 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -21.603 11.336 -12.142 1.00 0.00 H new ATOM 925 N ARG A 211 -26.718 13.855 -10.740 1.00 0.00 N ATOM 926 CA ARG A 211 -27.812 14.655 -11.294 1.00 0.00 C ATOM 927 C ARG A 211 -28.287 15.703 -10.298 1.00 0.00 C ATOM 928 O ARG A 211 -28.594 16.820 -10.688 1.00 0.00 O ATOM 929 CB ARG A 211 -28.966 13.744 -11.719 1.00 0.00 C ATOM 930 CG ARG A 211 -30.041 14.440 -12.538 1.00 0.00 C ATOM 931 CD ARG A 211 -30.895 13.409 -13.261 1.00 0.00 C ATOM 932 NE ARG A 211 -31.961 14.040 -14.061 1.00 0.00 N ATOM 933 CZ ARG A 211 -32.751 13.405 -14.924 1.00 0.00 C ATOM 934 NH1 ARG A 211 -32.642 12.120 -15.161 1.00 0.00 N ATOM 935 NH2 ARG A 211 -33.669 14.078 -15.561 1.00 0.00 N ATOM 0 H ARG A 211 -26.918 12.858 -10.662 1.00 0.00 H new ATOM 0 HA ARG A 211 -27.441 15.182 -12.173 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -28.564 12.914 -12.299 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -29.424 13.317 -10.827 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -30.667 15.051 -11.887 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -29.580 15.113 -13.261 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -30.262 12.806 -13.912 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -31.341 12.732 -12.532 1.00 0.00 H new ATOM 0 HE ARG A 211 -32.104 15.043 -13.944 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -31.932 11.570 -14.676 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -33.267 11.670 -15.830 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -33.775 15.079 -15.395 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -34.281 13.603 -16.225 1.00 0.00 H new ATOM 949 N HIS A 212 -28.332 15.361 -9.019 1.00 0.00 N ATOM 950 CA HIS A 212 -28.738 16.320 -7.992 1.00 0.00 C ATOM 951 C HIS A 212 -27.782 17.513 -7.950 1.00 0.00 C ATOM 952 O HIS A 212 -28.216 18.654 -7.883 1.00 0.00 O ATOM 953 CB HIS A 212 -28.769 15.643 -6.619 1.00 0.00 C ATOM 954 CG HIS A 212 -29.129 16.571 -5.502 1.00 0.00 C ATOM 955 ND1 HIS A 212 -30.355 17.167 -5.350 1.00 0.00 N ATOM 956 CD2 HIS A 212 -28.382 17.030 -4.459 1.00 0.00 C ATOM 957 CE1 HIS A 212 -30.315 17.932 -4.263 1.00 0.00 C ATOM 958 NE2 HIS A 212 -29.136 17.880 -3.675 1.00 0.00 N ATOM 0 H HIS A 212 -28.095 14.434 -8.665 1.00 0.00 H new ATOM 0 HA HIS A 212 -29.736 16.679 -8.243 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -29.486 14.822 -6.644 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -27.791 15.206 -6.416 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -27.351 16.767 -4.273 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -31.146 18.523 -3.906 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -28.844 18.363 -2.825 1.00 0.00 H new ATOM 966 N ASN A 213 -26.483 17.253 -8.000 1.00 0.00 N ATOM 967 CA ASN A 213 -25.495 18.335 -7.953 1.00 0.00 C ATOM 968 C ASN A 213 -25.549 19.186 -9.224 1.00 0.00 C ATOM 969 O ASN A 213 -25.367 20.396 -9.173 1.00 0.00 O ATOM 970 CB ASN A 213 -24.089 17.768 -7.756 1.00 0.00 C ATOM 971 CG ASN A 213 -23.787 17.465 -6.310 1.00 0.00 C ATOM 972 OD1 ASN A 213 -23.279 18.303 -5.585 1.00 0.00 O ATOM 973 ND2 ASN A 213 -24.106 16.277 -5.880 1.00 0.00 N ATOM 0 H ASN A 213 -26.087 16.316 -8.072 1.00 0.00 H new ATOM 0 HA ASN A 213 -25.738 18.975 -7.105 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -23.982 16.857 -8.345 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -23.357 18.481 -8.135 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -23.932 16.023 -4.908 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -24.530 15.601 -6.516 1.00 0.00 H new ATOM 980 N LEU A 214 -25.819 18.558 -10.360 1.00 0.00 N ATOM 981 CA LEU A 214 -25.947 19.288 -11.625 1.00 0.00 C ATOM 982 C LEU A 214 -27.206 20.153 -11.628 1.00 0.00 C ATOM 983 O LEU A 214 -27.256 21.190 -12.285 1.00 0.00 O ATOM 984 CB LEU A 214 -26.018 18.309 -12.802 1.00 0.00 C ATOM 985 CG LEU A 214 -24.715 17.592 -13.193 1.00 0.00 C ATOM 986 CD1 LEU A 214 -25.026 16.532 -14.238 1.00 0.00 C ATOM 987 CD2 LEU A 214 -23.681 18.566 -13.744 1.00 0.00 C ATOM 0 H LEU A 214 -25.954 17.550 -10.437 1.00 0.00 H new ATOM 0 HA LEU A 214 -25.070 19.927 -11.729 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -26.765 17.550 -12.567 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -26.380 18.853 -13.674 1.00 0.00 H new ATOM 0 HG LEU A 214 -24.295 17.132 -12.298 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -24.107 16.019 -14.521 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -25.732 15.811 -13.826 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -25.462 17.005 -15.118 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -22.774 18.022 -14.009 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -24.081 19.059 -14.630 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -23.447 19.315 -12.987 1.00 0.00 H new ATOM 999 N SER A 215 -28.220 19.731 -10.884 1.00 0.00 N ATOM 1000 CA SER A 215 -29.485 20.466 -10.804 1.00 0.00 C ATOM 1001 C SER A 215 -29.354 21.755 -10.000 1.00 0.00 C ATOM 1002 O SER A 215 -30.222 22.610 -10.066 1.00 0.00 O ATOM 1003 CB SER A 215 -30.571 19.595 -10.169 1.00 0.00 C ATOM 1004 OG SER A 215 -30.762 18.400 -10.912 1.00 0.00 O ATOM 0 H SER A 215 -28.195 18.880 -10.323 1.00 0.00 H new ATOM 0 HA SER A 215 -29.761 20.726 -11.826 1.00 0.00 H new ATOM 0 HB2 SER A 215 -30.293 19.350 -9.144 1.00 0.00 H new ATOM 0 HB3 SER A 215 -31.507 20.151 -10.121 1.00 0.00 H new ATOM 0 HG SER A 215 -30.092 17.737 -10.643 1.00 0.00 H new ATOM 1010 N LEU A 216 -28.265 21.901 -9.251 1.00 0.00 N ATOM 1011 CA LEU A 216 -28.034 23.128 -8.486 1.00 0.00 C ATOM 1012 C LEU A 216 -27.745 24.265 -9.462 1.00 0.00 C ATOM 1013 O LEU A 216 -28.083 25.411 -9.204 1.00 0.00 O ATOM 1014 CB LEU A 216 -26.848 22.962 -7.526 1.00 0.00 C ATOM 1015 CG LEU A 216 -26.977 21.860 -6.458 1.00 0.00 C ATOM 1016 CD1 LEU A 216 -25.654 21.727 -5.701 1.00 0.00 C ATOM 1017 CD2 LEU A 216 -28.110 22.150 -5.469 1.00 0.00 C ATOM 0 H LEU A 216 -27.535 21.195 -9.156 1.00 0.00 H new ATOM 0 HA LEU A 216 -28.922 23.350 -7.894 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -25.955 22.760 -8.118 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -26.685 23.912 -7.018 1.00 0.00 H new ATOM 0 HG LEU A 216 -27.215 20.927 -6.968 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -25.744 20.947 -4.945 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -24.860 21.465 -6.400 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -25.414 22.674 -5.218 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -28.165 21.347 -4.733 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -27.917 23.095 -4.961 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -29.056 22.214 -6.008 1.00 0.00 H new ATOM 1029 N HIS A 217 -27.121 23.904 -10.580 1.00 0.00 N ATOM 1030 CA HIS A 217 -26.805 24.803 -11.707 1.00 0.00 C ATOM 1031 C HIS A 217 -25.991 26.085 -11.434 1.00 0.00 C ATOM 1032 O HIS A 217 -25.717 26.850 -12.346 1.00 0.00 O ATOM 1033 CB HIS A 217 -28.094 25.151 -12.462 1.00 0.00 C ATOM 1034 CG HIS A 217 -28.109 24.649 -13.874 1.00 0.00 C ATOM 1035 ND1 HIS A 217 -27.990 23.327 -14.224 1.00 0.00 N ATOM 1036 CD2 HIS A 217 -28.209 25.319 -15.057 1.00 0.00 C ATOM 1037 CE1 HIS A 217 -28.028 23.241 -15.550 1.00 0.00 C ATOM 1038 NE2 HIS A 217 -28.167 24.423 -16.113 1.00 0.00 N ATOM 0 H HIS A 217 -26.807 22.947 -10.740 1.00 0.00 H new ATOM 0 HA HIS A 217 -26.108 24.210 -12.300 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -28.945 24.732 -11.926 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -28.223 26.233 -12.467 1.00 0.00 H new ATOM 0 HD1 HIS A 217 -27.890 22.545 -13.577 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -28.307 26.390 -15.156 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -27.954 22.314 -16.099 1.00 0.00 H new ATOM 1046 N SER A 218 -25.590 26.320 -10.193 1.00 0.00 N ATOM 1047 CA SER A 218 -24.814 27.511 -9.856 1.00 0.00 C ATOM 1048 C SER A 218 -23.434 27.520 -10.516 1.00 0.00 C ATOM 1049 O SER A 218 -22.946 28.561 -10.934 1.00 0.00 O ATOM 1050 CB SER A 218 -24.657 27.592 -8.341 1.00 0.00 C ATOM 1051 OG SER A 218 -24.210 26.346 -7.819 1.00 0.00 O ATOM 0 H SER A 218 -25.787 25.706 -9.403 1.00 0.00 H new ATOM 0 HA SER A 218 -25.357 28.377 -10.235 1.00 0.00 H new ATOM 0 HB2 SER A 218 -23.945 28.377 -8.085 1.00 0.00 H new ATOM 0 HB3 SER A 218 -25.609 27.864 -7.885 1.00 0.00 H new ATOM 0 HG SER A 218 -24.113 26.415 -6.846 1.00 0.00 H new ATOM 1057 N LYS A 219 -22.803 26.355 -10.597 1.00 0.00 N ATOM 1058 CA LYS A 219 -21.486 26.229 -11.221 1.00 0.00 C ATOM 1059 C LYS A 219 -21.557 25.433 -12.521 1.00 0.00 C ATOM 1060 O LYS A 219 -20.693 25.563 -13.379 1.00 0.00 O ATOM 1061 CB LYS A 219 -20.519 25.573 -10.223 1.00 0.00 C ATOM 1062 CG LYS A 219 -19.050 25.520 -10.665 1.00 0.00 C ATOM 1063 CD LYS A 219 -18.415 26.916 -10.874 1.00 0.00 C ATOM 1064 CE LYS A 219 -18.033 27.124 -12.344 1.00 0.00 C ATOM 1065 NZ LYS A 219 -17.379 28.440 -12.609 1.00 0.00 N ATOM 0 H LYS A 219 -23.182 25.479 -10.237 1.00 0.00 H new ATOM 0 HA LYS A 219 -21.120 27.223 -11.479 1.00 0.00 H new ATOM 0 HB2 LYS A 219 -20.577 26.114 -9.278 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -20.859 24.556 -10.029 1.00 0.00 H new ATOM 0 HG2 LYS A 219 -18.474 24.976 -9.917 1.00 0.00 H new ATOM 0 HG3 LYS A 219 -18.979 24.955 -11.594 1.00 0.00 H new ATOM 0 HD2 LYS A 219 -19.116 27.690 -10.562 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -17.530 27.016 -10.246 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -17.360 26.324 -12.653 1.00 0.00 H new ATOM 0 HE3 LYS A 219 -18.929 27.042 -12.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 -17.569 28.731 -13.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 -17.759 29.154 -11.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 -16.353 28.353 -12.466 1.00 0.00 H new ATOM 1079 N PHE A 220 -22.586 24.617 -12.667 1.00 0.00 N ATOM 1080 CA PHE A 220 -22.734 23.775 -13.852 1.00 0.00 C ATOM 1081 C PHE A 220 -23.809 24.343 -14.746 1.00 0.00 C ATOM 1082 O PHE A 220 -24.870 24.685 -14.268 1.00 0.00 O ATOM 1083 CB PHE A 220 -23.139 22.360 -13.448 1.00 0.00 C ATOM 1084 CG PHE A 220 -22.211 21.733 -12.454 1.00 0.00 C ATOM 1085 CD1 PHE A 220 -22.647 21.468 -11.139 1.00 0.00 C ATOM 1086 CD2 PHE A 220 -20.896 21.403 -12.818 1.00 0.00 C ATOM 1087 CE1 PHE A 220 -21.773 20.888 -10.193 1.00 0.00 C ATOM 1088 CE2 PHE A 220 -20.013 20.823 -11.882 1.00 0.00 C ATOM 1089 CZ PHE A 220 -20.452 20.571 -10.565 1.00 0.00 C ATOM 0 H PHE A 220 -23.335 24.516 -11.982 1.00 0.00 H new ATOM 0 HA PHE A 220 -21.780 23.747 -14.378 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -24.145 22.384 -13.029 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -23.180 21.734 -14.339 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -23.660 21.711 -10.852 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -20.556 21.595 -13.825 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -22.116 20.688 -9.189 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -19.004 20.573 -12.173 1.00 0.00 H new ATOM 0 HZ PHE A 220 -19.776 20.136 -9.843 1.00 0.00 H new ATOM 1099 N ILE A 221 -23.543 24.427 -16.036 1.00 0.00 N ATOM 1100 CA ILE A 221 -24.530 24.914 -16.990 1.00 0.00 C ATOM 1101 C ILE A 221 -24.770 23.785 -17.982 1.00 0.00 C ATOM 1102 O ILE A 221 -23.956 22.855 -18.084 1.00 0.00 O ATOM 1103 CB ILE A 221 -24.072 26.239 -17.695 1.00 0.00 C ATOM 1104 CG1 ILE A 221 -22.915 25.985 -18.678 1.00 0.00 C ATOM 1105 CG2 ILE A 221 -23.634 27.272 -16.643 1.00 0.00 C ATOM 1106 CD1 ILE A 221 -22.557 27.200 -19.560 1.00 0.00 C ATOM 0 H ILE A 221 -22.649 24.164 -16.451 1.00 0.00 H new ATOM 0 HA ILE A 221 -25.457 25.179 -16.481 1.00 0.00 H new ATOM 0 HB ILE A 221 -24.921 26.624 -18.259 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -22.032 25.687 -18.113 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -23.178 25.147 -19.323 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -23.318 28.188 -17.142 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -24.469 27.491 -15.978 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -22.804 26.870 -16.062 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -21.733 26.938 -20.224 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -23.425 27.486 -20.154 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -22.260 28.035 -18.926 1.00 0.00 H new ATOM 1118 N ARG A 222 -25.880 23.850 -18.701 1.00 0.00 N ATOM 1119 CA ARG A 222 -26.234 22.820 -19.675 1.00 0.00 C ATOM 1120 C ARG A 222 -26.264 23.458 -21.050 1.00 0.00 C ATOM 1121 O ARG A 222 -26.847 24.517 -21.233 1.00 0.00 O ATOM 1122 CB ARG A 222 -27.584 22.208 -19.311 1.00 0.00 C ATOM 1123 CG ARG A 222 -28.029 21.081 -20.236 1.00 0.00 C ATOM 1124 CD ARG A 222 -29.276 20.409 -19.693 1.00 0.00 C ATOM 1125 NE ARG A 222 -30.382 21.368 -19.529 1.00 0.00 N ATOM 1126 CZ ARG A 222 -31.560 21.094 -18.981 1.00 0.00 C ATOM 1127 NH1 ARG A 222 -31.864 19.898 -18.537 1.00 0.00 N ATOM 1128 NH2 ARG A 222 -32.448 22.043 -18.875 1.00 0.00 N ATOM 0 H ARG A 222 -26.557 24.609 -18.630 1.00 0.00 H new ATOM 0 HA ARG A 222 -25.499 22.015 -19.673 1.00 0.00 H new ATOM 0 HB2 ARG A 222 -27.535 21.827 -18.291 1.00 0.00 H new ATOM 0 HB3 ARG A 222 -28.341 22.992 -19.322 1.00 0.00 H new ATOM 0 HG2 ARG A 222 -28.227 21.477 -21.232 1.00 0.00 H new ATOM 0 HG3 ARG A 222 -27.229 20.348 -20.337 1.00 0.00 H new ATOM 0 HD2 ARG A 222 -29.583 19.611 -20.369 1.00 0.00 H new ATOM 0 HD3 ARG A 222 -29.051 19.945 -18.733 1.00 0.00 H new ATOM 0 HE ARG A 222 -30.231 22.320 -19.864 1.00 0.00 H new ATOM 0 HH11 ARG A 222 -31.185 19.140 -18.607 1.00 0.00 H new ATOM 0 HH12 ARG A 222 -32.780 19.726 -18.122 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -32.234 22.982 -19.211 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -33.357 21.846 -18.456 1.00 0.00 H new ATOM 1142 N VAL A 223 -25.619 22.804 -21.999 1.00 0.00 N ATOM 1143 CA VAL A 223 -25.451 23.317 -23.358 1.00 0.00 C ATOM 1144 C VAL A 223 -26.067 22.339 -24.358 1.00 0.00 C ATOM 1145 O VAL A 223 -26.004 21.116 -24.196 1.00 0.00 O ATOM 1146 CB VAL A 223 -23.918 23.635 -23.661 1.00 0.00 C ATOM 1147 CG1 VAL A 223 -23.013 23.050 -22.620 1.00 0.00 C ATOM 1148 CG2 VAL A 223 -23.481 23.267 -25.088 1.00 0.00 C ATOM 0 H VAL A 223 -25.190 21.890 -21.852 1.00 0.00 H new ATOM 0 HA VAL A 223 -25.981 24.264 -23.460 1.00 0.00 H new ATOM 0 HB VAL A 223 -23.823 24.719 -23.604 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -21.977 23.289 -22.862 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -23.263 23.467 -21.645 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -23.139 21.968 -22.595 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -22.427 23.512 -25.220 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -23.629 22.199 -25.250 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -24.077 23.829 -25.807 1.00 0.00 H new ATOM 1158 N GLN A 224 -26.686 22.888 -25.386 1.00 0.00 N ATOM 1159 CA GLN A 224 -27.274 22.083 -26.454 1.00 0.00 C ATOM 1160 C GLN A 224 -26.155 21.739 -27.433 1.00 0.00 C ATOM 1161 O GLN A 224 -25.253 22.535 -27.644 1.00 0.00 O ATOM 1162 CB GLN A 224 -28.368 22.867 -27.183 1.00 0.00 C ATOM 1163 CG GLN A 224 -29.593 23.160 -26.322 1.00 0.00 C ATOM 1164 CD GLN A 224 -30.660 23.913 -27.088 1.00 0.00 C ATOM 1165 OE1 GLN A 224 -30.440 25.015 -27.542 1.00 0.00 O ATOM 1166 NE2 GLN A 224 -31.820 23.321 -27.222 1.00 0.00 N ATOM 0 H GLN A 224 -26.798 23.894 -25.509 1.00 0.00 H new ATOM 0 HA GLN A 224 -27.726 21.183 -26.038 1.00 0.00 H new ATOM 0 HB2 GLN A 224 -27.951 23.809 -27.538 1.00 0.00 H new ATOM 0 HB3 GLN A 224 -28.680 22.305 -28.063 1.00 0.00 H new ATOM 0 HG2 GLN A 224 -30.007 22.223 -25.951 1.00 0.00 H new ATOM 0 HG3 GLN A 224 -29.293 23.743 -25.451 1.00 0.00 H new ATOM 0 HE21 GLN A 224 -31.968 22.393 -26.826 1.00 0.00 H new ATOM 0 HE22 GLN A 224 -32.576 23.788 -27.723 1.00 0.00 H new ATOM 1265 N SER A 232 -27.113 16.033 -24.238 1.00 0.00 N ATOM 1266 CA SER A 232 -26.897 17.381 -23.725 1.00 0.00 C ATOM 1267 C SER A 232 -25.502 17.482 -23.124 1.00 0.00 C ATOM 1268 O SER A 232 -25.026 16.545 -22.469 1.00 0.00 O ATOM 1269 CB SER A 232 -27.925 17.715 -22.647 1.00 0.00 C ATOM 1270 OG SER A 232 -29.242 17.483 -23.118 1.00 0.00 O ATOM 0 HA SER A 232 -27.002 18.085 -24.550 1.00 0.00 H new ATOM 0 HB2 SER A 232 -27.739 17.109 -21.760 1.00 0.00 H new ATOM 0 HB3 SER A 232 -27.819 18.758 -22.348 1.00 0.00 H new ATOM 0 HG SER A 232 -29.244 16.705 -23.714 1.00 0.00 H new ATOM 1276 N TRP A 233 -24.865 18.617 -23.337 1.00 0.00 N ATOM 1277 CA TRP A 233 -23.541 18.885 -22.815 1.00 0.00 C ATOM 1278 C TRP A 233 -23.712 19.496 -21.441 1.00 0.00 C ATOM 1279 O TRP A 233 -24.693 20.196 -21.185 1.00 0.00 O ATOM 1280 CB TRP A 233 -22.877 19.920 -23.708 1.00 0.00 C ATOM 1281 CG TRP A 233 -22.293 19.410 -24.947 1.00 0.00 C ATOM 1282 CD1 TRP A 233 -22.687 19.709 -26.199 1.00 0.00 C ATOM 1283 CD2 TRP A 233 -21.166 18.526 -25.097 1.00 0.00 C ATOM 1284 NE1 TRP A 233 -21.916 19.096 -27.128 1.00 0.00 N ATOM 1285 CE2 TRP A 233 -20.958 18.354 -26.496 1.00 0.00 C ATOM 1286 CE3 TRP A 233 -20.304 17.868 -24.197 1.00 0.00 C ATOM 1287 CZ2 TRP A 233 -19.919 17.559 -27.014 1.00 0.00 C ATOM 1288 CZ3 TRP A 233 -19.253 17.062 -24.715 1.00 0.00 C ATOM 1289 CH2 TRP A 233 -19.075 16.921 -26.122 1.00 0.00 C ATOM 0 H TRP A 233 -25.256 19.385 -23.882 1.00 0.00 H new ATOM 0 HA TRP A 233 -22.943 17.974 -22.774 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -23.616 20.680 -23.963 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -22.093 20.416 -23.136 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -23.517 20.359 -26.434 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -22.032 19.175 -28.138 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -20.439 17.974 -23.131 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -19.784 17.450 -28.080 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -18.584 16.553 -24.037 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -18.270 16.307 -26.498 1.00 0.00 H new ATOM 1300 N TRP A 234 -22.751 19.260 -20.570 1.00 0.00 N ATOM 1301 CA TRP A 234 -22.714 19.887 -19.263 1.00 0.00 C ATOM 1302 C TRP A 234 -21.319 20.463 -19.155 1.00 0.00 C ATOM 1303 O TRP A 234 -20.346 19.804 -19.521 1.00 0.00 O ATOM 1304 CB TRP A 234 -22.955 18.859 -18.162 1.00 0.00 C ATOM 1305 CG TRP A 234 -24.314 18.231 -18.241 1.00 0.00 C ATOM 1306 CD1 TRP A 234 -24.680 17.155 -18.985 1.00 0.00 C ATOM 1307 CD2 TRP A 234 -25.508 18.637 -17.545 1.00 0.00 C ATOM 1308 NE1 TRP A 234 -25.995 16.845 -18.808 1.00 0.00 N ATOM 1309 CE2 TRP A 234 -26.541 17.725 -17.915 1.00 0.00 C ATOM 1310 CE3 TRP A 234 -25.811 19.675 -16.640 1.00 0.00 C ATOM 1311 CZ2 TRP A 234 -27.848 17.812 -17.392 1.00 0.00 C ATOM 1312 CZ3 TRP A 234 -27.125 19.766 -16.109 1.00 0.00 C ATOM 1313 CH2 TRP A 234 -28.127 18.826 -16.490 1.00 0.00 C ATOM 0 H TRP A 234 -21.972 18.627 -20.749 1.00 0.00 H new ATOM 0 HA TRP A 234 -23.487 20.647 -19.150 1.00 0.00 H new ATOM 0 HB2 TRP A 234 -22.195 18.080 -18.226 1.00 0.00 H new ATOM 0 HB3 TRP A 234 -22.838 19.339 -17.191 1.00 0.00 H new ATOM 0 HD1 TRP A 234 -24.011 16.612 -19.636 1.00 0.00 H new ATOM 0 HE1 TRP A 234 -26.491 16.081 -19.267 1.00 0.00 H new ATOM 0 HE3 TRP A 234 -25.054 20.391 -16.355 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 -28.611 17.107 -17.687 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 -27.367 20.554 -15.411 1.00 0.00 H new ATOM 0 HH2 TRP A 234 -29.118 18.906 -16.069 1.00 0.00 H new ATOM 1324 N MET A 235 -21.209 21.686 -18.676 1.00 0.00 N ATOM 1325 CA MET A 235 -19.908 22.325 -18.542 1.00 0.00 C ATOM 1326 C MET A 235 -19.938 23.292 -17.382 1.00 0.00 C ATOM 1327 O MET A 235 -20.977 23.486 -16.759 1.00 0.00 O ATOM 1328 CB MET A 235 -19.510 23.047 -19.832 1.00 0.00 C ATOM 1329 CG MET A 235 -20.380 24.210 -20.200 1.00 0.00 C ATOM 1330 SD MET A 235 -19.784 25.053 -21.674 1.00 0.00 S ATOM 1331 CE MET A 235 -18.384 25.991 -20.986 1.00 0.00 C ATOM 0 H MET A 235 -21.998 22.258 -18.374 1.00 0.00 H new ATOM 0 HA MET A 235 -19.160 21.555 -18.351 1.00 0.00 H new ATOM 0 HB2 MET A 235 -18.483 23.398 -19.732 1.00 0.00 H new ATOM 0 HB3 MET A 235 -19.523 22.329 -20.652 1.00 0.00 H new ATOM 0 HG2 MET A 235 -21.399 23.862 -20.368 1.00 0.00 H new ATOM 0 HG3 MET A 235 -20.416 24.914 -19.369 1.00 0.00 H new ATOM 0 HE1 MET A 235 -17.963 26.635 -21.758 1.00 0.00 H new ATOM 0 HE2 MET A 235 -18.730 26.602 -20.152 1.00 0.00 H new ATOM 0 HE3 MET A 235 -17.619 25.298 -20.635 1.00 0.00 H new ATOM 1341 N LEU A 236 -18.800 23.889 -17.086 1.00 0.00 N ATOM 1342 CA LEU A 236 -18.698 24.828 -15.985 1.00 0.00 C ATOM 1343 C LEU A 236 -19.091 26.203 -16.490 1.00 0.00 C ATOM 1344 O LEU A 236 -18.806 26.539 -17.629 1.00 0.00 O ATOM 1345 CB LEU A 236 -17.258 24.860 -15.465 1.00 0.00 C ATOM 1346 CG LEU A 236 -16.703 23.502 -15.011 1.00 0.00 C ATOM 1347 CD1 LEU A 236 -15.230 23.632 -14.663 1.00 0.00 C ATOM 1348 CD2 LEU A 236 -17.480 22.919 -13.826 1.00 0.00 C ATOM 0 H LEU A 236 -17.929 23.740 -17.595 1.00 0.00 H new ATOM 0 HA LEU A 236 -19.358 24.525 -15.172 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -16.613 25.256 -16.249 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -17.205 25.556 -14.628 1.00 0.00 H new ATOM 0 HG LEU A 236 -16.822 22.808 -15.843 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -14.845 22.664 -14.342 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -14.677 23.970 -15.540 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -15.109 24.356 -13.857 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -17.047 21.959 -13.544 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -17.423 23.605 -12.981 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -18.523 22.778 -14.109 1.00 0.00 H new ATOM 1360 N ASN A 237 -19.732 26.995 -15.645 1.00 0.00 N ATOM 1361 CA ASN A 237 -20.080 28.363 -16.016 1.00 0.00 C ATOM 1362 C ASN A 237 -18.764 29.134 -16.270 1.00 0.00 C ATOM 1363 O ASN A 237 -17.902 29.196 -15.375 1.00 0.00 O ATOM 1364 CB ASN A 237 -20.907 29.036 -14.907 1.00 0.00 C ATOM 1365 CG ASN A 237 -21.401 30.407 -15.310 1.00 0.00 C ATOM 1366 OD1 ASN A 237 -20.661 31.184 -15.863 1.00 0.00 O ATOM 1367 ND2 ASN A 237 -22.643 30.695 -15.048 1.00 0.00 N ATOM 0 H ASN A 237 -20.021 26.721 -14.706 1.00 0.00 H new ATOM 0 HA ASN A 237 -20.693 28.364 -16.917 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -21.759 28.404 -14.658 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -20.300 29.122 -14.006 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -23.022 31.604 -15.312 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -23.237 30.011 -14.579 1.00 0.00 H new ATOM 1374 N PRO A 238 -18.587 29.710 -17.479 1.00 0.00 N ATOM 1375 CA PRO A 238 -17.329 30.403 -17.803 1.00 0.00 C ATOM 1376 C PRO A 238 -17.071 31.706 -17.055 1.00 0.00 C ATOM 1377 O PRO A 238 -15.929 32.079 -16.821 1.00 0.00 O ATOM 1378 CB PRO A 238 -17.487 30.720 -19.287 1.00 0.00 C ATOM 1379 CG PRO A 238 -18.941 30.754 -19.530 1.00 0.00 C ATOM 1380 CD PRO A 238 -19.526 29.734 -18.620 1.00 0.00 C ATOM 0 HA PRO A 238 -16.486 29.771 -17.523 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -17.025 31.676 -19.536 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -17.004 29.962 -19.904 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -19.349 31.743 -19.323 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -19.169 30.526 -20.571 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -20.533 30.007 -18.305 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -19.596 28.759 -19.102 1.00 0.00 H new